Thiazole-2-carboxylic acid - CAS 14190-59-1
Catalog: |
BB009268 |
Product Name: |
Thiazole-2-carboxylic acid |
CAS: |
14190-59-1 |
Synonyms: |
1,3-thiazole-2-carboxylic acid |
IUPAC Name: | 1,3-thiazole-2-carboxylic acid |
Description: | Thiazole-2-carboxylic acid (CAS# 14190-59-1) is a useful research chemical. |
Molecular Weight: | 129.14 |
Molecular Formula: | C4H3NO2S |
Canonical SMILES: | C1=CSC(=N1)C(=O)O |
InChI: | InChI=1S/C4H3NO2S/c6-4(7)3-5-1-2-8-3/h1-2H,(H,6,7) |
InChI Key: | IJVLVRYLIMQVDD-UHFFFAOYSA-N |
Boiling Point: | 310.6 °C at 760 mmHg |
Purity: | 98 % |
Density: | 1.525 g/cm3 |
Appearance: | White to off-white to light yellow to beige to light brown crystalline powder |
MDL: | MFCD02094169 |
LogP: | 0.84130 |
GHS Hazard Statement: | H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P312, P321, P322, P330, P332+P313, P337+P313, P362, P363, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
US-2016096830-A1 | Inhibitors of lysine gingipain | 20141006 |
US-2015307507-A1 | 3-oxo-tetrahydro-furo[3,2-b]pyrrol-4(5h)-yl) derivatives i | 20140423 |
WO-2015161924-A1 | 3-oxo-tetrahydro-furo[3,2-b]pyrrol-4(5h)-yl) derivatives ii | 20140423 |
WO-2015161928-A1 | 3-oxo-tetrahydro-furo[3,2-b]pyrrol-4(5h)-yl) derivatives i | 20140423 |
WO-2015140195-A1 | Novel compounds | 20140320 |
PMID | Publication Date | Title | Journal |
23124461 | 20121101 | 2,4-Dimethyl-1,3-thiazole-5-carboxylic acid: an X-ray structural study at 100 K and Hirshfeld surface analysis | Acta crystallographica. Section C, Crystal structure communications |
16820043 | 20060101 | Recent developments in our understanding of the renal basis of hyperuricemia and the development of novel antihyperuricemic therapeutics | Arthritis research & therapy |
14981641 | 20040101 | Evolution of beetle bioluminescence: the origin of beetle luciferin | Luminescence : the journal of biological and chemical luminescence |
11165875 | 20010201 | OPC-compounds prevent oxidant-induced carbonylation and depolymerization of the F-actin cytoskeleton and intestinal barrier hyperpermeability | Free radical biology & medicine |
Complexity: | 106 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 128.98844951 |
Formal Charge: | 0 |
Heavy Atom Count: | 8 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 128.98844951 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 78.4 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.8 |
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